Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 7/20 | 0.40 |
| ▸ | KDM6B | O15054 | 3/20 | 0.39 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5279933 | 0.98 | NOTUM (0.39) | NOTUMKDM6BMAP3K5KEAP1POLB | |
| SCHEMBL26723789 | 0.86 | KDM4E (0.55) | NOTUMKDM6BPOLBSMN1; SMN2KDM4E | |
| SCHEMBL4760703 | 0.73 | NPC1 (0.45) | NOTUMMAP3K5SMN1; SMN2KDM4EGLA | |
| Hydrochloric Acid SCHEMBL5279937 | 0.72 | NPC1 (0.44) | MAP3K5SMN1; SMN2KDM4EGLAALDH1A1 | |
| SCHEMBL2511323 | 0.71 | NPC1 (0.61) | NOTUMMAP3K5KEAP1POLBSMN1; SMN2 | |
| SCHEMBL22271756 | 0.71 | MALT1 (0.44) | NOTUMKEAP1POLBSMN1; SMN2KDM4E | |
| SCHEMBL4759243 | 0.69 | ALDH1A1 (0.45) | NOTUMKEAP1SMN1; SMN2KDM4EGLA | |
| SCHEMBL38661317 | 0.69 | GPR3 (0.39) | NOTUMMAP3K5KEAP1MAOAALDH1A1 | |
| SCHEMBL5451196 | 0.67 | HTR3A (0.51) | KDM4EALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL29472021 | 0.66 | KDM4E (0.44) | NOTUMMAP3K5KDM4EGLAALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1917013-A1 | USE OF AZABICYCLO HEXANE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007022980-A1 | USE OF AZABICYCLO HEXANE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 2007-03-01 | — | — | WO | disclosed |